AG000A86

113974-24-6 | Benzenemethanamine, 2-bromo-α-methyl-, (αR)-

AG000A86

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CAS Number	113974-24-6
Catalog Number	AG000A86(AGN-PC-0P5N9L)
Chemical Name	Benzenemethanamine, 2-bromo-α-methyl-, (αR)-
IUPAC Name	(1R)-1-(2-bromophenyl)ethanamine
InChI	InChI=1S/C8H10BrN/c1-6(10)7-4-2-3-5-8(7)9/h2-6H,10H2,1H3/t6-/m1/s1
InChI Key	DSAXBVQQKYZELF-ZCFIWIBFSA-N
MDL Number	MFCD06761910
Molecular Formula	C8H10BrN
Molecular Weight	200.0757
SMILES	C[C@@H](N)C1=CC=CC=C1Br
Synonyms	(R)-1-(2-Bromophenyl)ethanamine, 113974-24-6, (R)-1-(2-Bromophenyl)ethylamine, (1R)-1-(2-bromophenyl)ethanamine, (R)-1-(2-BROMO-PHENYL)-ETHYLAMINE, (1R)-1-(2-bromophenyl)ethan-1-amine, AC1M84EP, SCHEMBL1345820, CTK5J1781, DTXSID00368894, (R)-1-(2-Bromophenyl)ethaneamine, AC1Q2983, ZINC3411328, 2344AA, MFCD06761910, (R)-1-(2-bromophenyl)ethan-1-amine, ACN-053575, DS-6382, AJ-44998, J1236, ST24035134, EN300-87759, Benzenemethanamine, 2-bromo-alpha-methyl-, (alphaR)-, I14-36844, C8H10BrN, 1-(2-bromophenyl)ethanamine, Benzenemethanamine, 2-bromo-, CID2530260, Benzenemethanamine, 2-bromo--methyl-, (R)-,

Complexity	105
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Exact Mass	199g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	200.079g/mol
Monoisotopic Mass	199g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	26A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.9

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P280-P305+P351+P338-P310
UN Code

Certificate of Analysis

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